In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 4th, 2006 | 24 | No |
Popular Name: 4-amino-1-(3-fluorophenyl)-6,7,8,8a-tetrahydro-1H-naphthalene-2,2,3-tricarbonitrile 4-amino-1-(3-fluorophenyl)-6,7,8…
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 3.76 | 8.27 | -15.77 | 2 | 4 | 0 | 97 | 318.355 | 1 | ↓ |
Lo Low (pH 4.5-6) | 3.76 | 8.12 | -63.79 | 3 | 4 | 1 | 99 | 319.363 | 1 | ↓ |